Publications obtained by using VSC

Here are the scientific Publications of the various Projects on the VSC, while a collection of interesting articles for the general audience can be found in the main menu at Presscorner.
 



1139 entries found
with the tags:
  • Romain Robbes

    ACM
    VSC project: 71161
  • Singraber Andreas
    Compphysvienna/N2P2: Neural Network Potential Package 1.0.0
    Zenodo v1.0.0, (2018)
  • Prenner D, Hrachowitz M, Kaitna R
    Trigger characteristics of torrential flows from high to low alpine regions in Austria.
    The Science of the total environment 658, 958 (2018)
  • Sandler Isolde, Nogueira Juan J, Gonzalez Leticia
    Solvent reorganization triggers photo-induced solvated electron generation in phenol.
    Physical chemistry chemical physics : PCCP None, (2018)
  • Podewitz Maren, Wang Yin, Gkeka Paraskevi, von Grafenstein Susanne, Liedl Klaus R, Cournia Zoe
    Phase Diagram of a Stratum Corneum Lipid Mixture.
    The journal of physical chemistry. B 122, 10505 (2018)
  • Steiner Soner, Rogl Gerda, Michor Herwig, Rogl Peter, Giester Gerald, Goncalves Antonio Pereira
    Structure and properties of a novel boride: ThNi
    Dalton transactions (Cambridge, England : 2003) None, (2018)
  • Hellerschmied Andreas, McCallum Lucia, McCallum Jamie, Sun Jing, Bohm Johannes, Cao Jianfeng
    Observing APOD with the AuScope VLBI Array.
    Sensors (Basel, Switzerland) 18, (2018)
  • Schuetz Doris Alexandra, Richter Lars, Amaral Marta, Grandits Melanie, Graedler Ulrich, Musil Djordje, Buchstaller Hans-Peter, Eggenweiler Hans-Michael, Frech Matthias, Ecker Gerhard F
    Ligand Desolvation steers on-rate and impacts Drug Residence Time of Heat shock protein 90 (Hsp90) Inhibitors.
    Journal of medicinal chemistry None, (2018)
  • Baburin Igor, Varkevisser Rosanne, Schramm Anja, Saxena Priyanka, Beyl Stanislav, Szkokan Phillip, Linder Tobias, Stary-Weinzinger Anna, van der Heyden Marcel A G, Houtman Marien, Takanari Hiroki, Jonsson Malin, Beekman Jet H D, Hamburger Matthias, Vos Ma
    Dehydroevodiamine and hortiamine, alkaloids from the traditional Chinese herbal drug Evodia rutaecarpa, are I
    Pharmacological research None, (2018)
  • Failamani F, Podloucky R, Bursik J, Rogl G, Michor H, Muller H, Bauer E, Giester G, Rogl P
    Boron-phil and boron-phob structure units in novel borides Ni
    Dalton transactions (Cambridge, England : 2003) 47, 3303 (2018)
  • Acosta-Alvear Diego, Karagoez G. Elif, Froehlich Florian, Li Han, Walther Tobias C., Walter Peter
    The unfolded protein response and endoplasmic reticulum protein targeting machineries converge on the stress sensor IRE1
    ELIFE 7, e43036 (2018)
  • Ahmadi Somayeh, Roccon Alessio, Zonta Francesco, Soldati Alfredo
    Turbulent drag reduction in channel flow with viscosity stratified fluids
    COMPUTERS & FLUIDS 176, 260 (2018)
  • Menger Maximilian F. S. J., Plasser Felix, Mennucci Benedetta, Gonzalez Leticia
    Surface Hopping within an Exciton Picture. An Electrostatic Embedding Scheme
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION 14, 6139 (2018)
  • Ballicchia Mauro, Weinbub Josef, Nedjalkov Mihail
    Electron evolution around a repulsive dopant in a quantum wire: coherence effects
    NANOSCALE 10, 23037 (2018)
  • Gerbert David, Hofmann Oliver T., Tegeder Petra
    Formation of Occupied and Unoccupied Hybrid Bands at Interfaces between Metals and Organic Donors/Acceptors
    JOURNAL OF PHYSICAL CHEMISTRY C 122, 27554 (2018)
  • De Vetta Martina, Baig Omar, Steen Dorika, Nogueira Juan J., Gonzalez Leticia
    Assessing Configurational Sampling in the Quantum Mechanics/Molecular Mechanics Calculation of Temoporfin Absorption Spectrum and Triplet Density of States
    MOLECULES 23, 2932 (2018)
  • Mai Sebastian, Mohamadzade Abed, Marquetand Philipp, Gonzalez Leticia, Ullrich Susanne
    Simulated and Experimental Time-Resolved Photoelectron Spectra of the Intersystem Crossing Dynamics in 2-Thiouracil
    MOLECULES 23, 2836 (2018)
  • Gnam Lukas, Manstetten Paul, Hossinger Andreas, Selberherr Siegfried, Weinbub Josef
    Accelerating Flux Calculations Using Sparse Sampling
    MICROMACHINES 9, 550 (2018)
  • Cheng Bingqing, Dellago Christoph, Ceriotti Michele
    Theoretical prediction of the homogeneous ice nucleation rate: disentangling thermodynamics and kinetics
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS 20, 28732 (2018)
  • Cardelli Chiara, Tubiana Luca, Bianco Valentino, Nerattini Francesca, Dellago Christoph, Coluzza Ivan
    Heteropolymer Design and Folding of Arbitrary Topologies Reveals an Unexpected Role of Alphabet Size on the Knot Population
    MACROMOLECULES 51, 8346 (2018)
  • Triebl Robert, Kraberger Gernot J., Mravlje Jernej, Aichhorn Markus
    Spin-orbit coupling and correlations in three-orbital systems
    PHYSICAL REVIEW B 98, 205128 (2018)
  • Petritz Andreas, Krammer Markus, Sauter Eric, Gaertner Michael, Nascimbeni Giulia, Schrode Benedikt, Fian Alexander, Gold Herbert, Cojocaru Andreea, Karner-Petritz Esther, Resel Roland, Terfort Andreas, Zojer Egbert, Zharnikov Michael, Zojer Karin, Stadlo
    Embedded Dipole Self-Assembled Monolayers for Contact Resistance Tuning in p-Type and n-Type Organic Thin Film Transistors and Flexible Electronic Circuits
    ADVANCED FUNCTIONAL MATERIALS 28, 1804462 (2018)
  • Stooss V., Cavaletto S. M., Donsa S., Blaettermann A., Birk P., Keitel C. H., Brezinova I., Burgdoerfer J., Ott C., Pfeifer T.
    Real-Time Reconstruction of the Strong-Field-Driven Dipole Response
    PHYSICAL REVIEW LETTERS 121, 173005 (2018)
  • Lackner Peter, Hulva Jan, Koeck Eva-Maria, Mayr-Schmoelzer Wernfried, Choi Joong Il J., Penner Simon, Diebold Ulrike, Mittendorfer Florian, Redinger Josef, Kloetzer Bernhard, Parkinson Gareth S., Schmid Michael
    Water adsorption at zirconia: from the ZrO2(111)/Pt3Zr(0001) model system to powder samples
    JOURNAL OF MATERIALS CHEMISTRY A 6, 17587 (2018)
  • Maas Axel, Toerek Pascal
    The spectrum of an SU(3) gauge theory with a fundamental Higgs field
    ANNALS OF PHYSICS 397, 303 (2018)
  • Reszler Christian, Switanek Matthew Blaise, Truhetz Heimo
    Convection-permitting regional climate simulations for representing floods in small- and medium-sized catchments in the Eastern Alps
    NATURAL HAZARDS AND EARTH SYSTEM SCIENCES 18, 2653 (2018)
  • Mai Sebastian, Gattuso Hugo, Monari Antonio, Gonzalez Leticia
    Novel Molecular-Dynamics-Based Protocols for Phase Space Sampling in Complex Systems
    FRONTIERS IN CHEMISTRY 6, 495 (2018)
  • Mai Sebastian, Marquetand Philipp, Gonzalez Leticia
    Nonadiabatic dynamics: The SHARC approach
    WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE 8, e1370 (2018)
  • Holec David, Kostoglou Nikolaos, Tampaxis Christos, Babic Biljana, Mitterer Christian, Rebholz Claus
    Theory-guided metal-decoration of nanoporous carbon for hydrogen storage applications
    SURFACE & COATINGS TECHNOLOGY 351, 42 (2018)
  • Dhar Himadri Shekhar, Zens Matthias, Krimer Dmitry O., Rotter Stefan
    Variational Renormalization Group for Dissipative Spin-Cavity Systems: Periodic Pulses of Nonclassical Photons from Mesoscopic Spin Ensembles
    PHYSICAL REVIEW LETTERS 121, 133601 (2018)

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